Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.45 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19249261 | 0.85 | IDO1 (0.36) | L3MBTL1KMT2AMEN1MAPT | |
| SCHEMBL22084443 | 0.84 | BACE1 (0.40) | HPGDHSD17B10HDAC1KDM4EGAA | |
| SCHEMBL19248996 | 0.81 | HDAC1 (0.45) | POLBKMT2AMEN1HDAC1HDAC3 | |
| SCHEMBL9194246 | 0.70 | ALDH1A1 (0.69) | ALDH1A1L3MBTL1HPGDPOLBHSD17B10 | |
| SCHEMBL14000510 | 0.70 | ALDH1A1 (0.64) | ALDH1A1L3MBTL1HPGDPOLBHSD17B10 | |
| SCHEMBL22083883 | 0.69 | RORC (0.40) | ALDH1A1KMT2AMEN1HDAC1HDAC3 | |
| SCHEMBL28470020 | 0.69 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1HPGDPOLBHSD17B10 | |
| SCHEMBL22083949 | 0.68 | TAAR1 (0.35) | — | |
| SCHEMBL19249090 | 0.68 | TDP1 (0.33) | — | |
| SCHEMBL22084441 | 0.68 | POLB (0.48) | POLBKMT2AMEN1MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017133258-A1 | 1H-INDAZOLE DERIVATIVE AND USE THEREOF AS IDO INHIBITOR | 西华大学 | 2017-08-10 | — | — | WO | disclosed |